Basic information
- Standard SMILES
CC1(C)CCCN(C(=O)C2CC(C(=O)[O-])NC2c2ccccc2)C1- InChIKey
JMYOWUBXKNBMED-UHFFFAOYSA-M- Molecular formula
- C19H25N2O3-
- Average molar mass
- 329.4 g/mol
Names & identifiers
- Preferred name
- 4-(3,3-Dimethylpiperidinocarbonyl)-5-phenylpyrrolidine-2-carboxylate
- IUPAC
- 4-(3,3-dimethylpiperidine-1-carbonyl)-5-phenylpyrrolidine-2-carboxylate
Names & synonyms
JMYOWUBXKNBMED-UHFFFAOYSA-M4-(3,3-dimethylpiperidinocarbonyl)-5-phenylpyrrolidine-2-carboxylate
Database identifiers
- PubChem CID
- 86751925
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- -1
- Complexity
- 479
Related reactions
1 records
Compound notes
Loading…